SCHEMBL950629

SCHEMBL950629

FC(F)(F)c1cc(-c2ccco2)n(-c2ccccc2Cl)n1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RXRA P19793 3/20 0.52
NR1H2 P55055 3/20 0.52
NR1H3 Q13133 3/20 0.52
NR3C2 P08235 1/20 0.49
KDM4E B2RXH2 6/20 0.46
ALDH1A1 P00352 5/20 0.46
HPGD P15428 3/20 0.46
HSD17B10 Q99714 3/20 0.46
TSHR P16473 2/20 0.46
PTGS1 P23219 3/20 0.42
PTGS2 P35354 2/20 0.42
MAPT P10636 2/20 0.42
POLB P06746 2/20 0.41
TLR8 Q9NR97 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7230519 0.81 KDM4E (0.44) KDM4EALDH1A1HPGDHSD17B10TSHR
SCHEMBL27866193 0.81 KDM4E (0.44) KDM4EALDH1A1HPGDHSD17B10TSHR
SCHEMBL7230019 0.81 KDM4E (0.44) NR3C2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL950143 0.81 PTGS1 (0.64) NR3C2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL6763705 0.81 KDM4E (0.48) KDM4EALDH1A1HPGDHSD17B10TSHR
SCHEMBL7239926 0.81 MAPT (0.46) KDM4EALDH1A1HPGDHSD17B10TSHR
SCHEMBL17064914 0.81 PTGS1 (0.64) NR3C2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL12528203 0.80 KDM4E (0.66) KDM4EALDH1A1HPGDHSD17B10TSHR
SCHEMBL8689010 0.80 PTGS2 (0.47) KDM4EALDH1A1HPGDHSD17B10TSHR
SCHEMBL7237134 0.80 KDM4E (0.42) NR3C2KDM4EALDH1A1HPGDHSD17B10

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2121621-B1 LXR AND FXR MODULATORS EXELIXIS PATENT CO LLC (US) 2014-05-07 EP disclosed
EP-2121621-B1 LXR AND FXR MODULATORS EXELIXIS PATENT CO LLC (US) 2014-05-07 EP disclosed
US-7998995-B2 LXR and FXR modulators EXELIXIS PATENT COMPANY LLC (US) 2011-08-16 US disclosed
US-7998995-B2 LXR and FXR modulators EXELIXIS PATENT COMPANY LLC (US) 2011-08-16 US disclosed
US-7998995-B2 LXR and FXR modulators EXELIXIS PATENT COMPANY LLC (US) 2011-08-16 US disclosed
US-7968573-B2 Hydrazide compound and pesticidal use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-06-28 US disclosed
EP-1937664-B1 HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME SUMITOMO CHEMICAL CO (JP) 2011-06-15 EP disclosed
US-20110071291-A1 HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME IKEGAMI HIROSHI 2011-03-24 US disclosed
US-20110071291-A1 HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME IKEGAMI HIROSHI 2011-03-24 US disclosed
US-7867949-B2 Hydrazide compound and pesticidal use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-11 US disclosed
WO-2007043677-A1 HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-04-19 WO disclosed
CN-1298706-C Insecticidal diamides DU PONT (US) 2007-02-07 CN disclosed
US-7148217-B2 Iminobenzoxazines, iminobenzthiazines and iminoquinazolines for controlling invertebrate pests E. I. DU PONT DE NEMOURS AND COMPANY (US) 2006-12-12 US disclosed
US-20060258649-A1 Iminobenzoxazines, iminobenzthiazines and iminoquinazolines for controlling invertebrate pests SELBY THOMAS P 2006-11-16 US disclosed
CN-1568144-A Iminobenzoxazines, iminobenzthiazines and iminoquinazolines for controlling invertebrate pests DU PONT (US) 2005-01-19 CN disclosed
CN-1555364-A Insecticidal diamides �Ű˾ 2004-12-15 CN disclosed
US-20040214828-A1 Iminobenzoxazines, iminobenzthiazines and iminoquinazolines for controlling invertebrate pests E.I. DU PONT DE NEMOURS AND COMPANY 2004-10-28 US disclosed
US-20040063738-A1 Substituted heterocyclic phthalic acid diamide arthropodicides E.I. DU PONT DE NEMOURS AND COMPANY 2004-04-01 US disclosed
EP-1341780-A2 SUBSTITUTED HETEROCYCLIC PHTHALIC ACID DIAMIDE ARTHROPODICIDES E. I. du Pont de Nemours and Company (US) 2003-09-10 EP disclosed
WO-2002048137-A2 SUBSTITUTED HETEROCYCLIC PHTHALIC ACID DIAMIDE ARTHROPODICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2002-06-20 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040214828-A1 Iminobenzoxazines, iminobenzthiazines and iminoquinazolines for controlling invertebrate pests NR0B1, IPO5, RER1 RXRA 1529/4885NR1H2 748/4885NR1H3 2085/4885
US-20110071291-A1 HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME ACHE, H1-2, H1-0 RXRA 1418/4885NR1H2 2869/4885NR1H3 3657/4885
US-20040063738-A1 Substituted heterocyclic phthalic acid diamide arthropodicides DDT, QDPR, DDX6 RXRA 1630/4885NR1H2 4270/4885NR1H3 4602/4885
US-20060258649-A1 Iminobenzoxazines, iminobenzthiazines and iminoquinazolines for controlling invertebrate pests NR0B1, NR1I2, NR0B2 RXRA 653/4885NR1H2 12/4885NR1H3 56/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.